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1-tert-butyl-1H-indene

1-tert-butyl-1H-indene

Formula: C13H16

SMILES: CC(C)(C)C1C=CC2=CC=CC=C12

IUPAC: 1-tert-butyl-1H-indene

InChI: InChI=1/C13H16/c1-13(2,3)12-9-8-10-6-4-5-7-11(10)12/h4-9,12H,1-3H3

Composition: C (90.64%), H (9.36%)

Molar Mass: 172.271

Atom Count: 29

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 172.1252005152
Formal Charge 0
FSP3 0.38
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 0
Hydrogen Bond Donor Count 0
InChIKey IHHBPJRQKRVWAY-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 58.23
Topological Polar Surface Area 0
Polarizability 22.34
Ring Count 2
Rotatable Bond Count 1

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Purity LeadTime Formula UnitPrice
98% <10 Days C13H16 Quote Only